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Modeling Singlet Fission on a Quantum Computer

[Image: see text] We demonstrate a practical application of quantum computing by using it to investigate the linear H(4) molecule as a simple model for singlet fission. We use the Peeters-Devreese-Soldatov energy functional to calculate the necessary energetics based on the moments of the Hamiltonia...

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Detalles Bibliográficos
Autores principales: Claudino, Daniel, Peng, Bo, Kowalski, Karol, Humble, Travis S.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10291634/
https://www.ncbi.nlm.nih.gov/pubmed/37289995
http://dx.doi.org/10.1021/acs.jpclett.3c01106